5-[2,6-bis(fluoranyl)octoxy]-2-(4-decylphenyl)pyrimidine

Systemtic Name: 5-[2,6-bis(fluoranyl)octoxy]-2-(4-decylphenyl)pyrimidine Openeye Name: 2-(4-decylphenyl)-5-(2,6-difluorooctoxy)pyrimidine CAS Name: 2-(4-decylphenyl)-5-(2,6-difluorooctoxy)pyrimidine IUPAC Name: 2-(4-decylphenyl)-5-(2,6-difluorooctoxy)pyrimidine Traditional Name: 2-(4-decylphenyl)-5-(2,6-difluorooctoxy)pyrimidine Formula: C28H42F2N2O MolecularWeight: 460.642686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CCCC(CC)F)F

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CCCC(CC)F)F

InChI

InChI=1S/C28H42F2N2O/c1-3-5-6-7-8-9-10-11-13-23-16-18-24(19-17-23)28-31-20-27(21-32-28)33-22-26(30)15-12-14-25(29)4-2/h16-21,25-26H,3-15,22H2,1-2H3